3-[(E)-(2-azanyl-6-oxidanylidene-3,5-dihydropurin-8-yl)diazenyl]sulfanylpropanoic acid

Systemtic Name: 3-[(E)-(2-azanyl-6-oxidanylidene-3,5-dihydropurin-8-yl)diazenyl]sulfanylpropanoic acid Openeye Name: 3-[(E)-(2-amino-6-oxo-3,5-dihydropurin-8-yl)azo]sulfanylpropanoic acid CAS Name: 3-[[(E)-(2-amino-6-oxo-3,5-dihydropurin-8-yl)azo]thio]propanoic acid IUPAC Name: 3-[(E)-(2-amino-6-oxo-3,5-dihydropurin-8-yl)diazenyl]sulfanylpropanoic acid Traditional Name: 3-[[(E)-(2-amino-6-keto-3,5-dihydropurin-8-yl)azo]thio]propionic acid Formula: C8H9N7O3S MolecularWeight: 283.26716

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Descriptors Computed from Structure

Canonical SMILES:

C(CSN=NC1=NC2C(=N1)NC(=NC2=O)N)C(=O)O

Isomeric SMILES

C(CS/N=N/C1=NC2C(=N1)NC(=NC2=O)N)C(=O)O

InChI

InChI=1S/C8H9N7O3S/c9-7-11-5-4(6(18)13-7)10-8(12-5)14-15-19-2-1-3(16)17/h4H,1-2H2,(H,16,17)(H3,9,10,11,12,13,18)/b15-14+